%chk=000268047.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268047

0 1
O 1.517545 -1.227836 -0.053687
O 3.756786 0.351543 -0.766173
O 5.127642 -1.505744 -0.486353
O 0.703198 1.494324 0.251371
O 0.164438 1.625545 -1.949986
O -6.159234 -0.061006 0.864704
O -5.164566 -1.851955 1.560804
N -5.169272 -0.753216 1.031764
C 2.340388 -0.530026 0.943415
C 2.889192 -1.686167 0.141078
C 3.006618 0.744557 0.425922
C 3.835699 -1.085982 -0.903724
C 2.078540 1.874410 -0.028535
C 6.211007 -1.007697 -1.303944
C -0.146619 1.327251 -0.825830
C -1.446100 0.789810 -0.322148
C -2.610624 1.550479 -0.499347
C -1.486057 -0.470433 0.286987
C -3.833781 1.046361 -0.055438
C -2.707784 -0.982013 0.729544
C -3.868661 -0.215655 0.556436
H 1.959880 -0.566667 1.958109
H 3.023916 -2.709432 0.473348
H 3.769372 1.109326 1.151951
H 3.635642 -1.290183 -1.969103
H 2.215863 2.083352 -1.114341
H 2.216293 2.798514 0.559703
H 7.096727 -1.356009 -0.759256
H 6.177427 0.086522 -1.345077
H 6.159700 -1.450092 -2.302425
H -2.563641 2.527213 -0.986749
H -0.562484 -1.052225 0.409147
H -4.759331 1.620017 -0.180705
H -2.766318 -1.966986 1.206740


%chk=000268047-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268047

0 1
O 1.862852 -1.187923 1.373845
O 3.073638 0.152689 -0.745194
O 4.856433 -1.507679 -0.825793
O 0.843173 1.481482 0.718890
O 0.108755 2.786876 -1.079117
O -6.009732 -0.724575 -0.496650
O -4.953764 -2.291947 0.779515
N -4.968092 -1.189879 0.107749
C 3.052835 -0.279061 1.602144
C 3.233721 -1.582541 0.890869
C 3.203527 0.837211 0.570253
C 3.451745 -1.266549 -0.584541
C 2.217335 2.003998 0.608877
C 5.243460 -1.311558 -2.233862
C -0.088435 1.872998 -0.244555
C -1.341132 1.065744 -0.124500
C -2.505763 1.532964 -0.786909
C -1.362849 -0.153177 0.603239
C -3.703018 0.799119 -0.712004
C -2.555128 -0.898307 0.679242
C -3.706149 -0.406538 0.024919
H 3.328316 -0.118899 2.648280
H 3.677042 -2.480338 1.326740
H 4.227958 1.258521 0.677429
H 2.809886 -1.819634 -1.297609
H 2.306559 2.620999 -0.303006
H 2.401458 2.628884 1.500792
H 6.319110 -1.537376 -2.281549
H 5.056938 -0.269301 -2.549703
H 4.685068 -2.004683 -2.895144
H -2.451446 2.466866 -1.354829
H -0.444075 -0.508240 1.079074
H -4.619649 1.132947 -1.204335
H -2.609176 -1.843195 1.225642


